(phenylmethyl) 2-[(3S)-2-oxidanylidene-3-(phenylsulfonylcarbamoylamino)piperidin-1-yl]ethanoate

Systemtic Name: (phenylmethyl) 2-[(3S)-2-oxidanylidene-3-(phenylsulfonylcarbamoylamino)piperidin-1-yl]ethanoate Openeye Name: benzyl 2-[(3S)-3-(benzenesulfonylcarbamoylamino)-2-oxo-1-piperidyl]acetate CAS Name: 2-[(3S)-3-[[benzenesulfonamido(oxo)methyl]amino]-2-oxo-1-piperidinyl]acetic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[(3S)-3-(benzenesulfonylcarbamoylamino)-2-oxopiperidin-1-yl]acetate Traditional Name: 2-[(3S)-3-(besylcarbamoylamino)-2-keto-piperidino]acetic acid benzyl ester Formula: C21H23N3O6S MolecularWeight: 445.48882

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(C(=O)N(C1)CC(=O)OCC2=CC=CC=C2)NC(=O)NS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

C1C[C@@H](C(=O)N(C1)CC(=O)OCC2=CC=CC=C2)NC(=O)NS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H23N3O6S/c25-19(30-15-16-8-3-1-4-9-16)14-24-13-7-12-18(20(24)26)22-21(27)23-31(28,29)17-10-5-2-6-11-17/h1-6,8-11,18H,7,12-15H2,(H2,22,23,27)/t18-/m0/s1